(4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane
TL;DR: (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane (CAS 3393-00-8) is a chemical compound with molecular formula C13H11BrS and molecular weight 277.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-(4-methylsulfanylphenyl)benzene
Also Known As: 4-Bromo-4'-(methylthio)biphenyl, 4-bromo-4'-methylsulfanyl-biphenyl, (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane, 4'-Bromo-4-(methylthio)-biphenyl, 1-bromo-4-(4-methylsulfanylphenyl)benzene
| Molecular Formula | C13H11BrS |
|---|---|
| Molecular Weight | 277.98 g/mol |
| LogP | 4.838 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.97647 |
| Heavy Atoms | 15 |
| Complexity | 431.09805 |
Chemical Identifiers
| CAS Number | 3393-00-8 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C2=CC=C(C=C2)Br |
Product Overview
(4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane (CAS 3393-00-8), with molecular formula C13H11BrS and molecular weight 277.98 g/mol. IUPAC: 1-bromo-4-(4-methylsulfanylphenyl)benzene.
Chemical Property Profile of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane
Property Insights of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane
The XLogP value of 4.838 indicates that (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane?
The CAS number of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane is 3393-00-8.
What is the molecular formula of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane?
The molecular formula of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane is C13H11BrS.
What is the molecular weight of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane?
The molecular weight of (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane is 277.98 g/mol.
Where can I buy (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane?
You can request a quote for (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane?
Yes, KEHONG BIO provides custom synthesis services for (4'-Bromo-[1,1'-biphenyl]-4-yl)(methyl)sulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.